tetramethyl spiro[1,3-dithiole-2,4'-thiochromene]-2',3',4,5-tetracarboxylate

Systemtic Name: tetramethyl spiro[1,3-dithiole-2,4'-thiochromene]-2',3',4,5-tetracarboxylate Openeye Name: tetramethyl spiro[1,3-dithiole-2,4'-thiochromene]-2',3',4,5-tetracarboxylate CAS Name: spiro[1,3-dithiole-2,4'-1-benzothiopyran]-2',3',4,5-tetracarboxylic acid tetramethyl ester IUPAC Name: tetramethyl spiro[1,3-dithiole-2,4'-thiochromene]-2',3',4,5-tetracarboxylate Traditional Name: spiro[1,3-dithiole-2,4'-thiochromene]-2',3',4,5-tetracarboxylic acid tetramethyl ester Formula: C19H16O8S3 MolecularWeight: 468.52054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=CC=CC=C2C13SC(=C(S3)C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC2=CC=CC=C2C13SC(=C(S3)C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H16O8S3/c1-24-15(20)11-12(16(21)25-2)28-10-8-6-5-7-9(10)19(11)29-13(17(22)26-3)14(30-19)18(23)27-4/h5-8H,1-4H3